SCHEMBL20005872

SCHEMBL20005872

In1c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSPO P30536 3/20 0.39
▸ ALDH1A1 P00352 2/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ APP P05067 1/20 0.36
▸ MEN1 O00255 1/20 0.33
▸ CRHBP P24387 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ CRHR2 Q13324 1/20 0.33
▸ TLR9 Q9NR96 1/20 0.33
▸ NR4A2 P43354 2/20 0.33
▸ ICMT O60725 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL23052976 0.87 ALDH1A1 (0.42) ALDH1A1L3MBTL1KDM4ECYP1A2CYP3A4
SCHEMBL20005369 0.87 L3MBTL1 (0.47) TSPOALDH1A1L3MBTL1KDM4EMAPT
SCHEMBL20005582 0.87 L3MBTL1 (0.47) TSPOALDH1A1L3MBTL1KDM4EMAPT
SCHEMBL19558980 0.85 TSPO (0.41) TSPOALDH1A1KDM4ECYP1A2MAPT
SCHEMBL19998774 0.83 TSPO (0.42) TSPOALDH1A1L3MBTL1KDM4ECYP1A2
SCHEMBL19998688 0.83 TSPO (0.42) TSPOALDH1A1L3MBTL1KDM4ECYP1A2
SCHEMBL23052975 0.83 KDM4E (0.38) TSPOALDH1A1L3MBTL1KDM4ECYP1A2
SCHEMBL20707470 0.81 KDM4E (0.46) TSPOALDH1A1L3MBTL1KDM4ECYP1A2
SCHEMBL9913053 0.81 L3MBTL1 (0.41) TSPOALDH1A1L3MBTL1KDM4ECYP1A2
SCHEMBL15306476 0.81 KDM4E (0.46) TSPOALDH1A1L3MBTL1KDM4ECYP1A2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180090687-A1 CROSS-CONJUGATED POLYMER, MATERIAL FOR ELECTRONIC ELEMENT, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD (JP) 2018-03-29 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180090687-A1 CROSS-CONJUGATED POLYMER, MATERIAL FOR ELECTRONIC ELEMENT, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT SLC18A1, SLC1A2, SLC43A1 TSPO 225/4885ALDH1A1 764/4885L3MBTL1 1552/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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